create_new_bond Subroutine

public subroutine create_new_bond(top, i, j)

Uses

  • proc~~create_new_bond~~UsesGraph proc~create_new_bond create_new_bond module~mod_io mod_io proc~create_new_bond->module~mod_io module~mod_adjacency_mat mod_adjacency_mat proc~create_new_bond->module~mod_adjacency_mat module~mod_constants mod_constants module~mod_io->module~mod_constants module~mod_memory mod_memory module~mod_adjacency_mat->module~mod_memory iso_c_binding iso_c_binding module~mod_constants->iso_c_binding module~mod_memory->module~mod_io module~mod_memory->module~mod_constants module~mod_memory->iso_c_binding

Create a new bond between atoms i and j in the topology.

Arguments

Type IntentOptional Attributes Name
type(ommp_topology_type), intent(inout) :: top
integer(kind=ip), intent(in) :: i
integer(kind=ip), intent(in) :: j

Calls

proc~~create_new_bond~~CallsGraph proc~create_new_bond create_new_bond proc~fatal_error fatal_error proc~create_new_bond->proc~fatal_error proc~reallocate_mat reallocate_mat proc~create_new_bond->proc~reallocate_mat proc~ommp_message ommp_message proc~fatal_error->proc~ommp_message proc~close_output close_output proc~fatal_error->proc~close_output proc~close_output->proc~ommp_message

Called by

proc~~create_new_bond~~CalledByGraph proc~create_new_bond create_new_bond proc~add_link_atom add_link_atom proc~add_link_atom->proc~create_new_bond proc~ommp_create_link_atom ommp_create_link_atom proc~ommp_create_link_atom->proc~create_new_bond proc~ommp_create_link_atom->proc~add_link_atom proc~c_ommp_create_link_atom C_ommp_create_link_atom proc~c_ommp_create_link_atom->proc~ommp_create_link_atom

Contents